1-(2,3-二氢-1,4-苯并二氧杂环己-6-基)-1-丁酮 | 29668-47-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 1-(2,3-二氢-1,4-苯并二氧杂环己-6-基)-1-丁酮
• 英文名称: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one
• 英文别名: 1-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-butan-1-one；1-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-butan-1-on；1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-butanone
• CAS: 29668-47-1
• 化学式: C₁₂H₁₄O₃
• 分子量: 206.241
• InChiKey: XSWZTOLEGWPAAA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(2,3-二氢-1,4-苯并二氧杂环己-6-基)-1-丁酮 在 盐酸 、 sodium tetrahydroborate 作用下， 以 水 为溶剂， 反应 196.0h， 生成 6-(1-ethoxybutyl)-2,3-dihydro-1,4-benzodioxine
  参考文献：
  名称：

  Hydrochloric acid as an efficient catalyst for intermolecular condensation of alcohols. A simple and highly efficient synthesis of unsymmetrical ethers from benzylic alcohols and alkanols

  摘要：

  Benzylic alcohols and diarylmethanols with electron-donating substituents in the aromatic ring reacted with aliphatic alcohols in the presence of a catalytic amount of HCl to give the corresponding alkyl arylmethyl ethers. The reactivity of diarylmethanols in the intermolecular dehydration depended on the nature of substituents in the aromatic rings and structure of aliphatic alcohol.

  DOI：

  10.1134/s107042801509002x
• 作为产物：
  描述：

  1-(3,4-二羟基苯基)丁烷-1-酮 在 氢氧化钾 、 1,2-二溴乙烷 作用下， 生成 1-(2,3-二氢-1,4-苯并二氧杂环己-6-基)-1-丁酮
  参考文献：
  名称：

  1 (3' 4' dioxyalkylene phenyl) 2 aminoalkanol (1)

  摘要：

  公开号：

  US01964973A1

文献信息

• GAMMA-DIKETONES AS WNT/BETA-CATENIN SIGNALLING PATHWAY ACTIVATORS
  申请人：Samumed, LLC

  公开号：EP3456325A2

  公开（公告）日：2019-03-20

  The present disclosure provides γ-diketones or analogs thereof, that activate Wnt/β-catenin signaling and thus treat or prevent diseases related to signal transduction, such as osteoporosis and osteoarthropathy; osteogenesis imperfecta, bone defects, bone fractures, periodontal disease, otosclerosis, wound healing, craniofacial defects, oncolytic bone disease, traumatic brain injuries or spine injuries, brain atrophy/neurological disorders related to the differentiation and development of the central nervous system, including Parkinson's disease, strokes, ischemic cerebral disease, epilepsy, Alzheimer's disease, depression, bipolar disorder, schizophrenia; otic disorders like cochlear hair cell loss; eye diseases such as age related macular degeneration, diabetic macular edema or retinitis pigmentosa and diseases related to differentiation and growth of stem cell, such as hair loss, hematopoiesis related diseases and tissue regeneration related diseases.

  本公开提供了γ-二酮或其类似物，它们能激活Wnt/β-catenin信号转导，从而治疗或预防与信号转导有关的疾病，如骨质疏松症和骨关节病；成骨不全症、骨缺损、骨折、牙周病、耳硬化症、伤口愈合、颅面缺损、溶瘤性骨病、脑外伤或脊柱损伤、脑萎缩/与中枢神经系统分化和发育有关的神经系统疾病，包括帕金森病、中风、缺血性脑病、癫痫、阿尔茨海默病、抑郁症、躁狂症、精神分裂症；耳部疾病，如耳蜗毛细胞缺失；眼部疾病，如老年性黄斑变性、糖尿病性黄斑水肿或视网膜色素变性；以及与干细胞分化和生长有关的疾病，如脱发、造血相关疾病和组织再生相关疾病。
• 10.1007/s11172-024-4277-8
  作者：Aksenov、Grishin, I. Yu.、Grishin, Yu. I.、Aksenova

  DOI：10.1007/s11172-024-4277-8

  日期：——

  The mechanism of acylamination of arenes with nitroalkanes in polyphosphoric acid has been clarified. The influence of the concentration of polyphosphoric acid, the structure of the starting compounds, and temperature on the result of the Beckmann rearrangement, which makes it possible to shift the reaction towards either benzamides or anilides, has been assessed.

  阐明了多磷酸中芳烃与硝基烷烃酰基化的机理。已经评估了多磷酸的浓度、起始化合物的结构和温度对贝克曼重排结果的影响，贝克曼重排使得反应向苯甲酰胺或苯胺转移成为可能。
• Synthesis of quinolin-2-ones by an intramolecular Knoevenagel condensation and by tandem Michael–Knoevenagel heterocyclization
  作者：S. S. Mochalov、M. I. Chasanov、A. N. Fedotov、N. S. Zefirov

  DOI：10.1007/s10593-011-0881-2

  日期：2011.12

  The synthesis of 2-(N-R-amino)- and 2-(N-vinylcarbonylamino)acylbenzenes has been carried out and their heterocyclization into quinolin-2-ones under the action of sodium ethylate has been studied.
• Synthesis of symmetrical α-alkyl- and α-arylalkylbenzyl and diarylmethyl ethers by HCl-catalyzed intermolecular dehydration
  作者：S. S. Mochalov、A. N. Fedotov、E. V. Trofimova、N. S. Zefirov

  DOI：10.1134/s1070428017100050

  日期：2017.10

  alpha-Alkyl-, alpha-arylalkyl-, and alpha-aryl-substituted benzyl alcohols were converted into the corresponding symmetrical dibenzyl ethers in the presence of a catalytic amount of 10% aqueous HCl both in methylene chloride and under solvent-free conditions. Analogous reactions in dioxane and on heating afforded mainly the corresponding arylalkenes, whereas symmetrical dibenzyl ethers were formed as minor products.
• DE619332
  申请人：——

  公开号：——

  公开（公告）日：——